CTK1C5619
TL;DR: CTK1C5619 (CAS 37175-94-3) is a chemical compound with molecular formula C21H27N9O6 and molecular weight 501.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-bis[1-(2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine
Also Known As: N,N'-Bis(5-allyl-5-propylidenebarbituryl)diaminoguanidine, 5-Acetonyl-5-allylbarbituric acid 5,5'-imidocarbonyldihydrazone, BARBITURIC ACID, 5-ACETONYL-5-ALLYL-, 5,5'-IMIDOCARBONYLDIHYDRAZONE, Carbonimidic dihydrazide, bis(2-(hexahydro-2,4,6-trioxo-5-(2-propenyl)-5-pyrimidinyl)-1-methylethylidene)-
| Molecular Formula | C21H27N9O6 |
|---|---|
| Molecular Weight | 501.21 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 226.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 501.20844 |
| Heavy Atoms | 36 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 37175-94-3 |
|---|---|
| SMILES | CC(=NNC(=NN=C(C)CC1(C(=O)NC(=O)NC1=O)CC=C)N)CC2(C(=O)NC(=O)NC2=O)CC=C |
| InChIKey | RYTRCCAJIGDJOI-UHFFFAOYSA-N |
Product Overview
CTK1C5619 (CAS 37175-94-3), with molecular formula C21H27N9O6 and molecular weight 501.21 g/mol. IUPAC: 1,2-bis[1-(2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine.
Chemical Property Profile of CTK1C5619
Property Insights of CTK1C5619
The XLogP value of -1.3 indicates that CTK1C5619 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 226.0 Ų indicates high polarity, suggesting CTK1C5619 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK1C5619 has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK1C5619?
The CAS number of CTK1C5619 is 37175-94-3.
What is the molecular formula of CTK1C5619?
The molecular formula of CTK1C5619 is C21H27N9O6.
What is the molecular weight of CTK1C5619?
The molecular weight of CTK1C5619 is 501.21 g/mol.
Where can I buy CTK1C5619?
You can request a quote for CTK1C5619 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK1C5619?
Yes, KEHONG BIO provides custom synthesis services for CTK1C5619 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.